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        "molfile": "\n  Marvin  01132111442D          \n\n 20 19  0  0  1  0            999 V2000\n   10.4388   -3.9424    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   11.1532   -4.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   11.8677   -3.9424    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   12.5821   -4.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   13.2966   -3.9424    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0\n   12.8841   -3.2280    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0\n   13.7092   -3.2280    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0\n   16.5139   -4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.2283   -4.6101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.9427   -4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   18.6573   -4.6101    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.9427   -3.3725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   17.2283   -2.9601    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   16.5139   -3.3725    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   14.7255   -3.9424    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   14.0111   -5.1799    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   14.0111   -4.3549    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n   19.3718   -3.3725    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   20.0862   -4.6101    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0\n   19.3718   -4.1976    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0\n  2  3  1  0  0  0  0\n  3  4  1  0  0  0  0\n  4  5  1  0  0  0  0\n  8  9  1  0  0  0  0\n  9 10  2  0  0  0  0\n 10 11  1  0  0  0  0\n 10 12  1  0  0  0  0\n 12 13  2  0  0  0  0\n 13 14  1  0  0  0  0\n 14  8  2  0  0  0  0\n  5  6  1  1  0  0  0\n  5  7  1  0  0  0  0\n  1  2  1  0  0  0  0\n 11 20  1  0  0  0  0\n  5 17  1  0  0  0  0\n 17 15  2  0  0  0  0\n 17 16  1  0  0  0  0\n 20 18  2  0  0  0  0\n 20 19  1  0  0  0  0\nM  END",
        "smiles": "c1ccc(cc1)CC(=O)O.C(C[C@@]([H])(C(=O)O)N)CN",
        "formula": "C8H8O2.C5H12N2O2",
        "atropisomerism": "No",
        "charge": 0,
        "count": 1,
        "stereochemistry": "ABSOLUTE",
        "defined_stereo": 1,
        "ez_centers": 0,
        "molecular_weight": "268.3094",
        "optical_activity": "UNSPECIFIED",
        "references": [
          "c92080a3-ad91-4ca5-8b7c-ad695befdd2d",
          "80de0258-8851-4c3d-a2ba-f2dbc3d25da0"
        ],
        "stereo_centers": 1
      },
      "unii": "9D6YZ105SN"
    }
  ]
}